Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | VDR | P11473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL514092 | 1.00 | MCHR1 (0.46) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL305722 | 0.95 | SMN1; SMN2 (0.42) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 | |
| Hexadecylamine SCHEMBL7554404 | 0.92 | MCHR1 (0.42) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL8725762 | 0.91 | MCHR1 (0.42) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL14840202 | 0.86 | MCHR1 (0.47) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL10968741 | 0.85 | TDP1 (0.41) | ALDH1A1TSHRTDP1CA12CA2 | |
| SCHEMBL4456402 | 0.84 | TDP1 (0.42) | ALDH1A1TSHRTDP1CA12CA2 | |
| SCHEMBL4459094 | 0.84 | TDP1 (0.42) | ALDH1A1TSHRTDP1CA12CA2 | |
| SCHEMBL4607771 | 0.84 | CA2 (0.54) | ALDH1A1SMN1; SMN2CYP3A4LMNAHTT | |
| SCHEMBL306553 | 0.81 | SMN1; SMN2 (0.41) | MCHR1ALDH1A1SMN1; SMN2CYP2C9CYP2C19 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012013167-A2 | METHOD OF ELECTROSTATIC SPINNING OF POLYMER MELT | ELMARCO S.R.O, (CZ) | 2012-02-02 | — | — | WO | disclosed |